CID 210066

2-(1-methylpiperidyl)-3-phenylindene fumarate

Structural Information

Molecular Formula
C21H23N
SMILES
CN1CCC(CC1)C2=C(C3=CC=CC=C3C2)C4=CC=CC=C4
InChI
InChI=1S/C21H23N/c1-22-13-11-16(12-14-22)20-15-18-9-5-6-10-19(18)21(20)17-7-3-2-4-8-17/h2-10,16H,11-15H2,1H3
InChIKey
FFGBBIIQPNMIFC-UHFFFAOYSA-N
Compound name
1-methyl-4-(3-phenyl-1H-inden-2-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.18304 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.19032 170.8
[M+Na]+ 312.17226 176.7
[M-H]- 288.17576 179.2
[M+NH4]+ 307.21686 187.3
[M+K]+ 328.14620 170.2
[M+H-H2O]+ 272.18030 161.3
[M+HCOO]- 334.18124 189.0
[M+CH3COO]- 348.19689 181.4
[M+Na-2H]- 310.15771 172.0
[M]+ 289.18249 166.3
[M]- 289.18359 166.3
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