CID 18437373

4-methyltetrahydro-2h-pyran-4-amine

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(CCOCC1)N
InChI
InChI=1S/C6H13NO/c1-6(7)2-4-8-5-3-6/h2-5,7H2,1H3
InChIKey
HECZPOCJWCHBHK-UHFFFAOYSA-N
Compound name
4-methyloxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

426
Patents

115.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.5
[M+Na]+ 138.08894 133.9
[M+NH4]+ 133.13354 134.2
[M+K]+ 154.06288 126.8
[M-H]- 114.09244 127.4
[M+Na-2H]- 136.07439 130.3
[M]+ 115.09917 126.1
[M]- 115.10027 126.1
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

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