CID 4418670

5-methoxy-1,3,3-trimethylspiro[indoline-2,3'-[3h]naphtho[2,1-b]pyran]

Structural Information

Molecular Formula
C24H23NO2
SMILES
CC1(C2=C(C=CC(=C2)OC)N(C13C=CC4=C(O3)C=CC5=CC=CC=C54)C)C
InChI
InChI=1S/C24H23NO2/c1-23(2)20-15-17(26-4)10-11-21(20)25(3)24(23)14-13-19-18-8-6-5-7-16(18)9-12-22(19)27-24/h5-15H,1-4H3
InChIKey
NQATYCIDEOBKIP-UHFFFAOYSA-N
Compound name
5'-methoxy-1',3',3'-trimethylspiro[benzo[f]chromene-3,2'-indole]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

357.17288 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.180156 188.3
[M+Na]+ 380.162098 199.8
[M-H]- 356.165604 196.7
[M+NH4]+ 375.206703 207.9
[M+K]+ 396.136038 194.1
[M+H-H2O]+ 340.170140 178.1
[M+HCOO]- 402.171081 204.0
[M+CH3COO]- 416.186731 199.5
[M+Na-2H]- 378.147546 193.4
[M]+ 357.17233142 191.6
[M]- 357.17342858 191.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe