CID 21421150

Hexahydro-1h-furo[3,4-c]pyrrole

Structural Information

Molecular Formula
C6H11NO
SMILES
C1C2COCC2CN1
InChI
InChI=1S/C6H11NO/c1-5-3-8-4-6(5)2-7-1/h5-7H,1-4H2
InChIKey
HQQVXVKQOPZRBJ-UHFFFAOYSA-N
Compound name
3,3a,4,5,6,6a-hexahydro-1H-furo[3,4-c]pyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1274
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 122.5
[M+Na]+ 136.07328 128.9
[M-H]- 112.07678 124.2
[M+NH4]+ 131.11788 146.1
[M+K]+ 152.04722 128.7
[M+H-H2O]+ 96.081320 117.5
[M+HCOO]- 158.08226 141.5
[M+CH3COO]- 172.09791 136.0
[M+Na-2H]- 134.05873 127.6
[M]+ 113.08351 117.9
[M]- 113.08461 117.9
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