CID 6444431

2-pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butenyl)-, (z)-

Structural Information

Molecular Formula
C12H20N2O
SMILES
C1CCN(C1)C/C=C\CN2CCCC2=O
InChI
InChI=1S/C12H20N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h3-4H,1-2,5-11H2/b4-3-
InChIKey
HOYGXWYHYSYOHL-ARJAWSKDSA-N
Compound name
1-[(Z)-4-pyrrolidin-1-ylbut-2-enyl]pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.15756 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.164836 152.1
[M+Na]+ 231.146778 156.7
[M-H]- 207.150284 154.8
[M+NH4]+ 226.191383 171.3
[M+K]+ 247.120718 154.1
[M+H-H2O]+ 191.154820 143.9
[M+HCOO]- 253.155761 170.8
[M+CH3COO]- 267.171411 184.0
[M+Na-2H]- 229.132226 151.0
[M]+ 208.15701142 147.6
[M]- 208.15810858 147.6
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

No patent data available for this compound.