CID 214822

34332-00-8

Structural Information

Molecular Formula
C17H23N
SMILES
CC1(CC2=CC=CC=C2C1=C3CCN(CC3)C)C
InChI
InChI=1S/C17H23N/c1-17(2)12-14-6-4-5-7-15(14)16(17)13-8-10-18(3)11-9-13/h4-7H,8-12H2,1-3H3
InChIKey
KOMSQIFEBOSIMZ-UHFFFAOYSA-N
Compound name
4-(2,2-dimethyl-3H-inden-1-ylidene)-1-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

241.18304 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.19032 159.3
[M+Na]+ 264.17226 166.2
[M-H]- 240.17576 165.0
[M+NH4]+ 259.21686 180.6
[M+K]+ 280.14620 161.0
[M+H-H2O]+ 224.18030 151.9
[M+HCOO]- 286.18124 176.4
[M+CH3COO]- 300.19689 170.8
[M+Na-2H]- 262.15771 160.7
[M]+ 241.18249 154.3
[M]- 241.18359 154.3
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