CID 68766454

1245648-84-3

Structural Information

Molecular Formula
C9H16N2O3
SMILES
CC(C)(C)OC(=O)NC1CC(=O)NC1
InChI
InChI=1S/C9H16N2O3/c1-9(2,3)14-8(13)11-6-4-7(12)10-5-6/h6H,4-5H2,1-3H3,(H,10,12)(H,11,13)
InChIKey
PFHVTCWJHBHEFA-UHFFFAOYSA-N
Compound name
tert-butyl N-(5-oxopyrrolidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

200.11609 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.12337 145.9
[M+Na]+ 223.10531 151.5
[M-H]- 199.10881 146.5
[M+NH4]+ 218.14991 164.6
[M+K]+ 239.07925 150.5
[M+H-H2O]+ 183.11335 140.2
[M+HCOO]- 245.11429 164.9
[M+CH3COO]- 259.12994 181.7
[M+Na-2H]- 221.09076 148.7
[M]+ 200.11554 143.3
[M]- 200.11664 143.3
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