CID 78508

Nsc 81216

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CC=C(OC1)CN
InChI
InChI=1S/C6H11NO/c7-5-6-3-1-2-4-8-6/h3H,1-2,4-5,7H2
InChIKey
DVOBWGYOTJOCAJ-UHFFFAOYSA-N
Compound name
3,4-dihydro-2H-pyran-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

113.08406 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 121.7
[M+Na]+ 136.07328 132.8
[M+NH4]+ 131.11788 131.0
[M+K]+ 152.04722 127.2
[M-H]- 112.07678 125.8
[M+Na-2H]- 134.05873 127.8
[M]+ 113.08351 124.3
[M]- 113.08461 124.3
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