CID 54595885

4-(2,5-dihydro-1h-pyrrol-1-yl)piperidine

Structural Information

Molecular Formula
C9H16N2
SMILES
C1CNCCC1N2CC=CC2
InChI
InChI=1S/C9H16N2/c1-2-8-11(7-1)9-3-5-10-6-4-9/h1-2,9-10H,3-8H2
InChIKey
JVDTWAMFTGWSKS-UHFFFAOYSA-N
Compound name
4-(2,5-dihydropyrrol-1-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

152.13135 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.13863 135.3
[M+Na]+ 175.12057 139.4
[M-H]- 151.12407 136.6
[M+NH4]+ 170.16517 154.1
[M+K]+ 191.09451 136.9
[M+H-H2O]+ 135.12861 127.3
[M+HCOO]- 197.12955 152.2
[M+CH3COO]- 211.14520 146.4
[M+Na-2H]- 173.10602 138.7
[M]+ 152.13080 126.8
[M]- 152.13190 126.8
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