CID 1514342

191347-94-1

Structural Information

Molecular Formula
C10H17NO3
SMILES
CC(C)(C)OC(=O)N1CC[C@H](C1)C=O
InChI
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h7-8H,4-6H2,1-3H3/t8-/m1/s1
InChIKey
DWLADVOODHZCFV-MRVPVSSYSA-N
Compound name
tert-butyl (3R)-3-formylpyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1144
Patents

199.12085 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12813 145.7
[M+Na]+ 222.11007 152.4
[M-H]- 198.11357 147.7
[M+NH4]+ 217.15467 165.7
[M+K]+ 238.08401 152.1
[M+H-H2O]+ 182.11811 140.3
[M+HCOO]- 244.11905 165.0
[M+CH3COO]- 258.13470 182.3
[M+Na-2H]- 220.09552 148.2
[M]+ 199.12030 146.3
[M]- 199.12140 146.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe