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

50
Patents

357.17288 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.18016 188.3
[M+Na]+ 380.16210 199.8
[M-H]- 356.16560 196.7
[M+NH4]+ 375.20670 207.9
[M+K]+ 396.13604 194.1
[M+H-H2O]+ 340.17014 178.1
[M+HCOO]- 402.17108 204.0
[M+CH3COO]- 416.18673 199.5
[M+Na-2H]- 378.14755 193.4
[M]+ 357.17233 191.6
[M]- 357.17343 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